(3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium

C38H68N2O8Y — CID 59982897

About (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium

(3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium (PubChem CID 59982897) has the molecular formula C38H68N2O8Y and a molecular weight of 769.87 g/mol. Its IUPAC name is (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium.

Molecular Properties

• Compound Name: (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium
• PubChem CID: 59982897
• Molecular Formula: C38H68N2O8Y
• Molecular Weight: 769.87 g/mol
• Exact Mass: 769.40
• IUPAC Name: (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium
• SMILES: CC[C@H]1OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](OC2OC(C)CC(N(C)C)C2C)[C@](C)(OC)C[C@@H](C)/C(=N/OC2CCCCC2)[C@H](C)[C@@H](O)C1(C)C.[Y]
• InChI: InChI=1S/C38H68N2O8.Y/c1-14-30-37(8,9)33(42)25(5)31(39-48-28-18-16-15-17-19-28)22(2)21-38(10,44-13)34(26(6)32(41)27(7)35(43)46-30)47-36-24(4)29(40(11)12)20-23(3)45-36;/h22-30,33-34,36,42H,14-21H2,1-13H3;/b39-31-;/t22-,23?,24?,25+,26+,27-,29?,30-,33-,34-,36?,38-;/m1./s1
• InChIKey: FTRMAWORFWATFJ-DQCXSWAOSA-N
• XLogP: 6.41
• TPSA: 116.12 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 10
• Rotatable Bonds: 7
• Heavy Atoms: 49
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	769.87
LogP ≤ 5	6.41
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium?

The IUPAC name of (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium (CID 59982897) is (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium.

What is the SMILES notation for (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium?

The canonical SMILES for (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium is CC[C@H]1OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](OC2OC(C)CC(N(C)C)C2C)[C@](C)(OC)C[C@@H](C)/C(=N/OC2CCCCC2)[C@H](C)[C@@H](O)C1(C)C.[Y].

What is the InChIKey of (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium?

The InChIKey is FTRMAWORFWATFJ-DQCXSWAOSA-N. The full InChI is InChI=1S/C38H68N2O8.Y/c1-14-30-37(8,9)33(42)25(5)31(39-48-28-18-16-15-17-19-28)22(2)21-38(10,44-13)34(26(6)32(41)27(7)35(43)46-30)47-36-24(4)29(40(11)12)20-23(3)45-36;/h22-30,33-34,36,42H,14-21H2,1-13H3;/b39-31-;/t22-,23?,24?,25+,26+,27-,29?,30-,33-,34-,36?,38-;/m1./s1.

What are the key properties of (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium?

(3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium has a molecular weight of 769.87 g/mol, XLogP of 6.41, 7 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for (3R,5R,6R,7R,9R,10Z,11S,12R,14R)-10-cyclohexyloxyimino-6-[4-(dimethylamino)-3,6-dimethyloxan-2-yl]oxy-14-ethyl-12-hydroxy-7-methoxy-3,5,7,9,11,13,13-heptamethyl-oxacyclotetradecane-2,4-dione;yttrium is sourced from PubChem (CID 59982897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).